[2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 2-phenylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 2-phenylsulfanylpyridine-3-carboxylate Openeye Name: [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl 2-phenylsulfanylpyridine-3-carboxylate CAS Name: 2-(phenylthio)-3-pyridinecarboxylic acid [2-(N-acetyl-3-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-methylanilino)-1,3-thiazol-4-yl]methyl 2-phenylsulfanylpyridine-3-carboxylate Traditional Name: 2-(phenylthio)nicotinic acid [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl ester Formula: C25H21N3O3S2 MolecularWeight: 475.58254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C25H21N3O3S2/c1-17-8-6-9-20(14-17)28(18(2)29)25-27-19(16-32-25)15-31-24(30)22-12-7-13-26-23(22)33-21-10-4-3-5-11-21/h3-14,16H,15H2,1-2H3